ethyl 2-[(4-fluorophenyl)methylcarbamothioylamino]-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxylate

Systemtic Name: ethyl 2-[(4-fluorophenyl)methylcarbamothioylamino]-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxylate Openeye Name: ethyl 2-[(4-fluorophenyl)methylcarbamothioylamino]-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxylate CAS Name: 2-[[[(4-fluorophenyl)methylamino]-sulfanylidenemethyl]amino]-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-fluorophenyl)methylcarbamothioylamino]-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxylate Traditional Name: 2-[(4-fluorobenzyl)thiocarbamoylamino]-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxylic acid ethyl ester Formula: C18H19FN2O2S3 MolecularWeight: 410.549063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCSC2)NC(=S)NCC3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCSC2)NC(=S)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H19FN2O2S3/c1-2-23-17(22)15-13-7-8-25-10-14(13)26-16(15)21-18(24)20-9-11-3-5-12(19)6-4-11/h3-6H,2,7-10H2,1H3,(H2,20,21,24)